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CPEDJTDUTIAVOW-SWMYPXFDSA-N

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CPEDJTDUTIAVOW-SWMYPXFDSA-N
SpectraBase Compound ID 4HTCntxj1J3
InChI InChI=1S/C52H54N4/c1-5-35-55(36-6-2)43-29-23-39(24-30-43)27-33-49-51(47-21-13-17-41-15-9-11-19-45(41)47)54-50(52(53-49)48-22-14-18-42-16-10-12-20-46(42)48)34-28-40-25-31-44(32-26-40)56(37-7-3)38-8-4/h9-34H,5-8,35-38H2,1-4H3/b33-27+,34-28+
InChIKey CPEDJTDUTIAVOW-SWMYPXFDSA-N
Mol Weight 735.0 g/mol
Molecular Formula C52H54N4
Exact Mass 734.434848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COwl6Bu7WhS
Name CPEDJTDUTIAVOW-SWMYPXFDSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H54N4
InChI InChI=1S/C52H54N4/c1-5-35-55(36-6-2)43-29-23-39(24-30-43)27-33-49-51(47-21-13-17-41-15-9-11-19-45(41)47)54-50(52(53-49)48-22-14-18-42-16-10-12-20-46(42)48)34-28-40-25-31-44(32-26-40)56(37-7-3)38-8-4/h9-34H,5-8,35-38H2,1-4H3/b33-27+,34-28+
InChIKey CPEDJTDUTIAVOW-SWMYPXFDSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 735.028 g/mol
Source File Reference MHKO27095